SCHEMBL13224537

SCHEMBL13224537

CC(C)(C=O)Cc1c[nH]cn1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
HIF1A Q16665 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL502258 0.81
SCHEMBL73986 0.78 ESR1 (0.32)
SCHEMBL21345875 0.77
SCHEMBL7176145 0.75 SLC6A2 (0.34)
SCHEMBL502576 0.73 BRS3 (0.31)
SCHEMBL22482128 0.73
SCHEMBL12311899 0.73 ALDH1A1 (0.33) ALDH1A1
SCHEMBL22384006 0.73
SCHEMBL28400748 0.71
SCHEMBL11192016 0.70 MEN1 (0.35) MEN1USP2ALDH1A1CYP1A2CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9422349-B2 N-terminal modified exendin-4 HANMI SCIENCE CO., LTD (KR) 2016-08-23 US disclosed
US-9072794-B2 Long-acting glucagon conjugate and pharmaceutical composition comprising the same for the prevention and treatment of obesity HANMI SCIENCE CO., LTD (KR) 2015-07-07 US disclosed
US-8895281-B2 Method for preparing a site-specific physiologically active polypeptide conjugate HANMI SCIENCE CO., LTD (KR) 2014-11-25 US disclosed
US-8476230-B2 Insulinotropic complex using an immunoglobulin fragment HANMI SCIENCE CO., LTD (KR) 2013-07-02 US disclosed
US-20130122023-A1 NOVEL LONG-ACTING GLUCAGON CONJUGATE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FOR THE PREVENTION AND TREATMENT OF OBESITY HANMI SCIENCE CO., LTD. (KR) 2013-05-16 US disclosed
US-20100204451-A1 INSULINOTROPIC PEPTIDE DERIVATIVE WHEREIN ITS N-TERMINAL AMINO ACID IS MODIFIED HANMI PHARMACEUTICAL CO., LTD. (KR) 2010-08-12 US disclosed
US-20100105877-A1 AN INSULINOTROPIC COMPLEX USING AN IMMUNOGLOBULIN FRAGMENT HANMI PHARMACEUTICAL CO., LTD. (KR) 2010-04-29 US disclosed
US-20090238838-A1 INSULINOTROPIC PEPTIDE CONJUGATE USING AN IMMUNOGLOBULIN FC HANMI PHARM. IND. CO. LTD. (KR) 2009-09-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100204451-A1 INSULINOTROPIC PEPTIDE DERIVATIVE WHEREIN ITS N-TERMINAL AMINO ACID IS MODIFIED IAPP, GLP1R, GPR119 MEN1 133/4885USP2 3199/4885ALDH1A1 4760/4885
US-20130122023-A1 NOVEL LONG-ACTING GLUCAGON CONJUGATE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FOR THE PREVENTION AND TREATMENT OF OBESITY GLP1R, GIPR, GCG MEN1 1168/4885USP2 1215/4885ALDH1A1 4270/4885
US-20090238838-A1 INSULINOTROPIC PEPTIDE CONJUGATE USING AN IMMUNOGLOBULIN FC IAPP, GPR119, INSR MEN1 483/4885USP2 3412/4885ALDH1A1 4507/4885
US-20100105877-A1 AN INSULINOTROPIC COMPLEX USING AN IMMUNOGLOBULIN FRAGMENT IAPP, INSR, GPR119 MEN1 590/4885USP2 3991/4885ALDH1A1 4738/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.